Cas no 1042510-31-5 (N-(3-fluorobenzyl)-2-(trifluoromethyl)aniline)
1042510-31-5 structure
Product Name:N-(3-fluorobenzyl)-2-(trifluoromethyl)aniline
CAS No:1042510-31-5
MF:C14H11F4N
MW:269.237457513809
CID:1142140
PubChem ID:29769094
Update Time:2025-04-20
N-(3-fluorobenzyl)-2-(trifluoromethyl)aniline Chemical and Physical Properties
Names and Identifiers
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- N-(3-Fluorobenzyl)-2-(trifluoromethyl)aniline
- N-[(3-fluorophenyl)methyl]-2-(trifluoromethyl)aniline
- 1042510-31-5
- AKOS009060079
- N-(3-Fluorobenzyl)-2-(trifluoroMethyl)aniline, 97%
- N-(3-fluorobenzyl)-2-(trifluoromethyl)aniline
-
- MDL： MFCD12619721
- Inchi： 1S/C14H11F4N/c15-11-5-3-4-10(8-11)9-19-13-7-2-1-6-12(13)14(16,17)18/h1-8,19H,9H2
- InChI Key： YAMCOSLUVUTNMC-UHFFFAOYSA-N
- SMILES： FC(C1C=CC=CC=1NCC1C=CC=C(C=1)F)(F)F
Computed Properties
- Exact Mass: 269.08276200g/mol
- Monoisotopic Mass: 269.08276200g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 279
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 12?2
N-(3-fluorobenzyl)-2-(trifluoromethyl)aniline Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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